AD09857
913836-10-9 | 3-Borono-2-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD09857
ChemicalName
3-Borono-2-methoxybenzoic acid
CasNumber
913836-10-9
MolecularFormula
C8H9BO5
MolecularWeight
195.9651
MdlNumber
MFCD09027237
Smiles
COc1c(cccc1C(=O)O)B(O)O
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
3
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CatalogNumber: AD09857
ChemicalName: 3-Borono-2-methoxybenzoic acid
CasNumber: 913836-10-9
MolecularFormula: C8H9BO5
MolecularWeight: 195.9651
MdlNumber: MFCD09027237
Smiles: COc1c(cccc1C(=O)O)B(O)O
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AD09857
ChemicalName:
3-Borono-2-methoxybenzoic acid
CasNumber:
913836-10-9
MolecularFormula:
C8H9BO5
MolecularWeight:
195.9651
MdlNumber:
MFCD09027237
Smiles:
COc1c(cccc1C(=O)O)B(O)O
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: AD09858
ChemicalName: 3-[N-Cyclopropyl-N-(4-methoxybenzyl)sulfamoyl]phenylboronic acid
CasNumber: 913836-07-4
MolecularFormula: C17H20BNO5S
MolecularWeight: 361.2204
MdlNumber: MFCD09027233
Smiles: COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C1CC1
Complexity: 526
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AD09858
ChemicalName:
3-[N-Cyclopropyl-N-(4-methoxybenzyl)sulfamoyl]phenylboronic acid
CasNumber:
913836-07-4
MolecularFormula:
C17H20BNO5S
MolecularWeight:
361.2204
MdlNumber:
MFCD09027233
Smiles:
COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C1CC1
Complexity:
526
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
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Smiles: COc1c(C)cc(cc1C)C(=O)CCCCCC(=O)O
Complexity: __
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Smiles:
COc1c(C)cc(cc1C)C(=O)CCCCCC(=O)O
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Smiles: CCC(C(=O)c1cccc(c1)C#N)(C)C
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Smiles:
CCC(C(=O)c1cccc(c1)C#N)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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